2-(5-O-Phosphono-β-D-Ribofuranosyl)-1,2,4-Triazine-3,5(2H,4H)-Dione

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Formula C8H12N3O9P
IUPAC Name [(2r,3s,4r,5r)-5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 325.169 g·mol−1
Heat of Formation -1785.6 ± 16.7 kJ·mol−1
Dipole Moment 4.86 ± 1.08 D
Volume 316.91 Å 3
Surface Area 277.65 Å 2
HOMO Energy -10.26 ± 0.55 eV
LUMO Energy -1.30 ± eV
Point Group Symmetry C1
Synonyms
  • 1,2,4-triazine-3,5(2h,4h)-dione, 2-(5-o-phosphono-beta-d-ribofuranosyl)-
  • 6-aza uridine 5'-monophosphate
  • 6-aza-ump
  • 6-azauridine 5'm
  • 6-azauridine 5'mp
  • 6-azauridine-5'-monophosphate
  • 6-azauridine-5'-phosphate
  • [(2r,3s,4r,5r)-5-(3,5-diketo-1,2,4-triazin-2-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxy-oxolan-2-yl]methyl dihydrogen phosphate
  • [(2r,3s,4r,5r)-5-(3,5-dioxo-1,2,4-triazin-2-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
  • aza ump
  • up6
CAS Number(s)
  • 2018-19-1
  • 33037-49-9
InChIKey LRVZOSYMNMNQFR-SHUUEZRQSA-N
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